1-cyano-6-(4-methylphenyl)cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 1-cyano-6-(4-methylphenyl)cyclohex-3-ene-1-carboxylic acid Openeye Name: 1-cyano-6-(p-tolyl)cyclohex-3-ene-1-carboxylic acid CAS Name: 1-cyano-6-(4-methylphenyl)-1-cyclohex-3-enecarboxylic acid IUPAC Name: 1-cyano-6-(4-methylphenyl)cyclohex-3-ene-1-carboxylic acid Traditional Name: 1-cyano-6-(p-tolyl)cyclohex-3-ene-1-carboxylic acid Formula: C15H15NO2 MolecularWeight: 241.2851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC=CCC2(C#N)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2CC=CCC2(C#N)C(=O)O

InChI

InChI=1S/C15H15NO2/c1-11-5-7-12(8-6-11)13-4-2-3-9-15(13,10-16)14(17)18/h2-3,5-8,13H,4,9H2,1H3,(H,17,18)